| Properties | Image |
|---|
| MNX_ID | MNXM1184876 |
 |
| reference | envipathM:...bbe70c0bf47a |
| formula | C19H17ClFN4O7 |
| global charge | -1 |
| mol weight | 467.817 |
| InChIKey | JEDCJIWYWJXZGJ-BUVRLJJBSA-M |
| InChI | InChI=1S/C19H18ClFN4O7/c1-10(13(20)19(26)27)31-16-14(21)17(23-9-22-16)32-12-6-4-3-5-11(12)15(24-28-2)18-25-30-8-7-29-18/h3-6,9-10,13H,7-8H2,1-2H3,(H,26,27)/p-1/b24-15+ |
| SMILES | CO/N=C(\C1=CC=CC=C1OC1=C(F)C(OC(C)C(Cl)C(=O)[O-])=NC=N1)C1=NOCCO1 |
MNX internals
| InChI (mnx) | InChI=1/C19H18ClFN4O7/c1-10(13(20)19(26)27)31-16-14(21)17(23-9-22-16)32-12-6-4-3-5-11(12)15(24-28-2)18-25-30-8-7-29-18/h3-6,9-10,13H,7-8H2,1-2H3,(H,26,27)/b24-15+/t10?,13? |
 |
| SMILES (mnx) | [CH3:1][CH:10]([CH:13]([C:19](=[O:26])[OH:27])[Cl:20])[O:31][C:16]1=[C:14]([F:21])[C:17]([O:32][C:12]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:11]2/[C:15]([C:18]2=[N:25][O:30][CH2:8][CH2:7][O:29]2)=[N:24]\[O:28][CH3:2])=[N:23][CH:9]=[N:22]1 |
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